Mol:FL1C19NP0003

 
 
Copyright: ARM project http://www.metabolome.jp/ 
 24 26  0  0  0  0  0  0  0  0999 V2000 
   -1.3767    0.5390    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -1.3767   -0.1034    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -0.8204   -0.4246    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -0.2641   -0.1034    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -0.2641    0.5390    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -0.8204    0.8602    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    0.2922   -0.4246    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    0.8485   -0.1034    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    1.4046   -0.4244    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    1.9607   -0.1034    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    2.5217   -0.4273    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    3.0827   -0.1034    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    3.0827    0.5444    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    2.5217    0.8683    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    1.9607    0.5444    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    0.2922   -0.9259    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
   -0.8204   -1.0669    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
   -1.9330    0.8602    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
   -2.4893    0.5390    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -2.4893   -0.1034    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -1.9330   -0.4246    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -2.7941    1.0669    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -3.0827    0.3800    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -3.0454   -0.4244    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
  1  2  1  0  0  0  0 
  2  3  2  0  0  0  0 
  3  4  1  0  0  0  0 
  4  5  2  0  0  0  0 
  5  6  1  0  0  0  0 
  6  1  2  0  0  0  0 
  4  7  1  0  0  0  0 
  7  8  1  0  0  0  0 
  8  9  2  0  0  0  0 
  9 10  1  0  0  0  0 
 10 11  2  0  0  0  0 
 11 12  1  0  0  0  0 
 12 13  2  0  0  0  0 
 13 14  1  0  0  0  0 
 14 15  2  0  0  0  0 
 15 10  1  0  0  0  0 
  7 16  2  0  0  0  0 
 17  3  1  0  0  0  0 
  1 18  1  0  0  0  0 
 18 19  1  0  0  0  0 
 19 20  1  0  0  0  0 
 20 21  1  0  0  0  0 
 21  2  1  0  0  0  0 
 19 22  1  0  0  0  0 
 19 23  1  0  0  0  0 
 20 24  1  0  0  0  0 
S  SKP  8 
ID	FL1C19NP0003 
KNApSAcK_ID	C00007051 
NAME	Flemistrictin C 
CAS_RN	61235-36-7 
FORMULA	C20H20O4 
EXACTMASS	324.136159128 
AVERAGEMASS	324.37039999999996 
SMILES	c(c(O)3)(ccc(c32)OC(C)(C)C(O)C2)C(=O)C=Cc(c1)cccc1 
M  END